Vitas-M small molecule compound
(2E)-N-(5,7-diphenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-(4-methoxyphenyl)prop-2-enamide
Catalog ID
STL238968
SMILES COc1ccc(cc1)/C=C/C(=O)Nc1nn2c(n1)NC(CC2c1ccccc1)c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H25N5O2 MW 451.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2/c1-34-22-15-12-19(13-16-22)14-17-25(33)29-26-30-27-28-23(20-8-4-2-5-9-20)18-24(32(27)31-26)21-10-6-3-7-11-21/h2-17,23-24H,18H2,1H3,(H2,28,29,30,31,33)/b17-14+InChIKey
JSLJGINKCOAHFS-SAPNQHFASA-NSynonyms
845991-72-2(2E)N(57diphenyl4567tetrahydro(124)triazolo(15a)pyrimidin2yl)3(4methoxyphenyl)prop2enamide
(E)N(57diphenyl1567tetrahydro(124)triazolo(15a)pyrimidin2yl)3(4methoxyphenyl)prop2enamide
(E)N(57diphenyl4567tetrahydro(124)triazolo(15a)pyrimidin2yl)3(4methoxyphenyl)acrylamide
845991722
COC1=CC=C(C=C1)C=CC(=O)NC2=NC3=NC(CC(N3N2)C4=CC=CC=C4)C5=CC=CC=C5
COc1ccc(cc1)C=CC(=O)Nc1nn2c(n1)NC(CC2c1ccccc1)c1ccccc1
InChI=1SC27H25N5O2c13422151219(131622)141725(33)292630272823(208425920)1824(32(27)3126)21106371121h2172324H18H21H3(H22829303133)b1714+
MFCD04171841
ZINC000002420219
ZINC000013769738
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